A rigorous and optimized strategy for the evaluation of the Boys function kernel in molecular electronic structure theory

Publisher: John Wiley & Sons Inc

E-ISSN: 1096-987x|36|18|1390-1398

ISSN: 0192-8651

Source: JOURNAL OF COMPUTATIONAL CHEMISTRY, Vol.36, Iss.18, 2015-07, pp. : 1390-1398

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Abstract